8-ethoxy-3-(2-piperazin-4-ium-1-ylethyl)-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 8-ethoxy-3-(2-piperazin-4-ium-1-ylethyl)-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 8-ethoxy-3-(2-piperazin-4-ium-1-ylethyl)-5H-pyrimido[5,4-b]indol-4-one CAS Name: 8-ethoxy-3-[2-(1-piperazin-4-iumyl)ethyl]-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 8-ethoxy-3-(2-piperazin-4-ium-1-ylethyl)-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 8-ethoxy-3-(2-piperazin-4-ium-1-ylethyl)-5H-pyrimid[5,4-b]indol-4-one Formula: C18H24N5O2+ MolecularWeight: 342.41546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)CCN4CC[NH2+]CC4

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)CCN4CC[NH2+]CC4

InChI

InChI=1S/C18H23N5O2/c1-2-25-13-3-4-15-14(11-13)16-17(21-15)18(24)23(12-20-16)10-9-22-7-5-19-6-8-22/h3-4,11-12,19,21H,2,5-10H2,1H3/p+1